>compound Indole_Indole
#instrument UPLC Q-Tof Premier, Waters
>formula C8H7N
#smiles c(c2)cc(c1)c(c2)nc1
#RECORD LC-ESI-QTOF_train_data/PR100053.txt
>charge 1
>ionization [M+H]+
>parentmass 118.06565

>collision 5-60
118.0657 9.258
118.0949 0.7862

